| SpectraBase Spectrum ID |
9gMXcuyFFSJ |
| Name |
peo 5000 allyl |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
5002.993566630 u |
| Formula |
C228H456O113 |
| InChI |
InChI=1S/C228H456O113/c1-3-4-230-7-8-232-11-12-234-15-16-236-19-20-238-23-24-240-27-28-242-31-32-244-35-36-246-39-40-248-43-44-250-47-48-252-51-52-254-55-56-256-59-60-258-63-64-260-67-68-262-71-72-264-75-76-266-79-80-268-83-84-270-87-88-272-91-92-274-95-96-276-99-100-278-103-104-280-107-108-282-111-112-284-115-116-286-119-120-288-123-124-290-127-128-292-131-132-294-135-136-296-139-140-298-143-144-300-147-148-302-151-152-304-155-156-306-159-160-308-163-164-310-167-168-312-171-172-314-175-176-316-179-180-318-183-184-320-187-188-322-191-192-324-195-196-326-199-200-328-203-204-330-207-208-332-211-212-334-215-216-336-219-220-338-223-224-340-227-228-341-226-225-339-222-221-337-218-217-335-214-213-333-210-209-331-206-205-329-202-201-327-198-197-325-194-193-323-190-189-321-186-185-319-182-181-317-178-177-315-174-173-313-170-169-311-166-165-309-162-161-307-158-157-305-154-153-303-150-149-301-146-145-299-142-141-297-138-137-295-134-133-293-130-129-291-126-125-289-122-121-287-118-117-285-114-113-283-110-109-281-106-105-279-102-101-277-98-97-275-94-93-273-90-89-271-86-85-269-82-81-267-78-77-265-74-73-263-70-69-261-66-65-259-62-61-257-58-57-255-54-53-253-50-49-251-46-45-249-42-41-247-38-37-245-34-33-243-30-29-241-26-25-239-22-21-237-18-17-235-14-13-233-10-9-231-6-5-229-2/h3H,1,4-228H2,2H3 |
| InChIKey |
ANATYFWORWKHLD-UHFFFAOYSA-N |
| Molecular Weight |
5006.043 g/mol |
| Nominal Mass |
5000 u |
| SMILES |
COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCC=C |
