| SpectraBase Spectrum ID |
BbBCSpGyHJX |
| Name |
1-Propene, 3-isothiocyanato- |
| CAS Registry Number |
57-06-7 |
| Classification |
Isothiocyanates |
| Comments |
Generally Recognized as Safe; NTIS Accession Number: PB254528 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
99.014270339 u |
| Formula |
C4H5NS |
| InChI |
InChI=1S/C4H5NS/c1-2-3-5-4-6/h2H,1,3H2 |
| InChIKey |
ZOJBYZNEUISWFT-UHFFFAOYSA-N |
| Molecular Weight |
99.151 g/mol |
| Number of Peaks |
59 |
| SMILES |
C=CCN=C=S |
| SPLASH |
splash10-000g-9000000000-63d78e5c85908d9965aa |
| Source of Spectrum |
XW-508-0-0 |
| Synonyms |
2-Propenyl isothiocyanate
3-iso-Thiocyanatoprop-1-ene
3-Isothiocyanato-1-propene
AITC
Allyl isosulfocyanate
Allyl isosulphocyanate
Allyl isothiocyanate, non-perfume grade
Allyl mustard oil
Allyl sevenolum
Allyl thioisocyanate
Allylisothiokyanat
Allylsenevol
Allylsenfoel
Allyspol
Allyspol 75EC
Artificial mustard oil
Artificial oil of mustard
Carbospol
Isothiocyanate d'allyle
Isothiocyanic acid, allyl ester
Isothiocyansaeureallylester
Mustard oil
Mustard oil, volatile
Mustard oil, volatile, synthetic
Oil of mustard
Oil of mustard, artificial
Oleum sinapis
Oleum sinapis volatile
Potassium allyl isothiocyanate
Potassium, (1-isothiocyanato-2-propenyl)-
Propene, 3-isothiocyanato-
Redskin
Senf oel
Synthetic mustard oil
Volatile mustard oil
Volatile oil of mustard
AI3-15283
ALLYL ISOTHIOCYANATE, STABILIZED
BRN 0773748
CASWELL NO. 027
CCRIS 20
EINECS 200-309-2
EPA PESTICIDE CHEMICAL CODE 004901
FEMA NO. 2034
HSDB 617
NCI-C50464
NSC 5572
OIL OF MUSTARD BPC 1949 |
| Wiley ID |
1119066 |
