CID 25010753
7-(methylsulfanyl)heptanal oxime
Structural Information
- Molecular Formula
- C8H17NOS
- SMILES
- CSCCCCCC/C=N/O
- InChI
- InChI=1S/C8H17NOS/c1-11-8-6-4-2-3-5-7-9-10/h7,10H,2-6,8H2,1H3/b9-7+
- InChIKey
- LLTRNSKZFVUNLQ-VQHVLOKHSA-N
- Compound name
- (NE)-N-(7-methylsulfanylheptylidene)hydroxylamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 176.11037 | 140.5 |
[M+Na]+ | 198.09231 | 149.2 |
[M+NH4]+ | 193.13691 | 148.4 |
[M+K]+ | 214.06625 | 140.6 |
[M-H]- | 174.09581 | 140.7 |
[M+Na-2H]- | 196.07776 | 143.2 |
[M]+ | 175.10254 | 142.0 |
[M]- | 175.10364 | 142.0 |