CID 10261445

2-methoxy-3-phenylpropan-1-ol

Structural Information

Molecular Formula
C10H14O2
SMILES
COC(CC1=CC=CC=C1)CO
InChI
InChI=1S/C10H14O2/c1-12-10(8-11)7-9-5-3-2-4-6-9/h2-6,10-11H,7-8H2,1H3
InChIKey
BNCXGTPWJTZUHD-UHFFFAOYSA-N
Compound name
2-methoxy-3-phenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

166.09938 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.10666 136.1
[M+Na]+ 189.08860 142.3
[M-H]- 165.09210 138.1
[M+NH4]+ 184.13320 155.9
[M+K]+ 205.06254 140.8
[M+H-H2O]+ 149.09664 130.4
[M+HCOO]- 211.09758 158.3
[M+CH3COO]- 225.11323 176.6
[M+Na-2H]- 187.07405 142.0
[M]+ 166.09883 136.7
[M]- 166.09993 136.7
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