For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-Methyl-5-nitro-3-heptanol

View entire compound with spectra: 2 MS (GC)

2-Methyl-5-nitro-3-heptanol
SpectraBase Compound ID CLbtZSjll35
InChI InChI=1S/C8H17NO3/c1-4-7(9(11)12)5-8(10)6(2)3/h6-8,10H,4-5H2,1-3H3
InChIKey UTRUJYJHKKIORJ-UHFFFAOYSA-N
Mol Weight 175.23 g/mol
Molecular Formula C8H17NO3
Exact Mass 175.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID E1tRUCiv0IY
Name 2-Methyl-5-nitro-3-heptanol
Alternate Name(s) 2-Methyl-5-nitro-heptan-3-ol 3-Heptanol, 2-methyl-5-nitro-, (R*,R*)-
CAS Registry Number 103077-90-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H17NO3
InChI InChI=1S/C8H17NO3/c1-4-7(9(11)12)5-8(10)6(2)3/h6-8,10H,4-5H2,1-3H3
InChIKey UTRUJYJHKKIORJ-UHFFFAOYSA-N
Molecular Weight 175.228 g/mol
SMILES OC(CC(CC)N(=O)=O)C(C)C
SPLASH splash10-0avl-9100000000-462cdfab40bbc5918f3f
Wiley ID 1490078