CID 5468147
(e)-3,4-dihydro-2-((4-hydroxyphenyl)methylene)-1(2h)-naphthalenone
Structural Information
- Molecular Formula
- C17H14O2
- SMILES
- C1C/C(=C\C2=CC=C(C=C2)O)/C(=O)C3=CC=CC=C31
- InChI
- InChI=1S/C17H14O2/c18-15-9-5-12(6-10-15)11-14-8-7-13-3-1-2-4-16(13)17(14)19/h1-6,9-11,18H,7-8H2/b14-11+
- InChIKey
- SRJMKMQJTLCMRQ-SDNWHVSQSA-N
- Compound name
- (2E)-2-[(4-hydroxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 251.10666 | 155.3 |
[M+Na]+ | 273.08860 | 162.9 |
[M-H]- | 249.09210 | 161.5 |
[M+NH4]+ | 268.13320 | 172.8 |
[M+K]+ | 289.06254 | 157.1 |
[M+H-H2O]+ | 233.09664 | 148.1 |
[M+HCOO]- | 295.09758 | 174.9 |
[M+CH3COO]- | 309.11323 | 167.2 |
[M+Na-2H]- | 271.07405 | 160.4 |
[M]+ | 250.09883 | 152.0 |
[M]- | 250.09993 | 152.0 |