CID 1549677
4-methoxycinnamonitrile
Structural Information
- Molecular Formula
- C10H9NO
- SMILES
- COC1=CC=C(C=C1)/C=C/C#N
- InChI
- InChI=1S/C10H9NO/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-7H,1H3/b3-2+
- InChIKey
- CNBCNHHPIBKYBO-NSCUHMNNSA-N
- Compound name
- (E)-3-(4-methoxyphenyl)prop-2-enenitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 160.07570 | 135.1 |
[M+Na]+ | 182.05764 | 147.8 |
[M+NH4]+ | 177.10224 | 140.3 |
[M+K]+ | 198.03158 | 137.6 |
[M-H]- | 158.06114 | 130.1 |
[M+Na-2H]- | 180.04309 | 139.8 |
[M]+ | 159.06787 | 134.7 |
[M]- | 159.06897 | 134.7 |