CID 73848

9-anthracenemethanol

Structural Information

Molecular Formula
C15H12O
SMILES
C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CO
InChI
InChI=1S/C15H12O/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-9,16H,10H2
InChIKey
JCJNNHDZTLRSGN-UHFFFAOYSA-N
Compound name
anthracen-9-ylmethanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

22
References

3851
Patents

208.08882 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.09610 142.3
[M+Na]+ 231.07804 152.4
[M-H]- 207.08154 147.1
[M+NH4]+ 226.12264 163.0
[M+K]+ 247.05198 147.0
[M+H-H2O]+ 191.08608 136.0
[M+HCOO]- 253.08702 164.7
[M+CH3COO]- 267.10267 156.0
[M+Na-2H]- 229.06349 152.9
[M]+ 208.08827 143.6
[M]- 208.08937 143.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe