CID 10899050

3-methoxy-1-phenylpropan-1-ol

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

166.09938 Da
Monoisotopic Mass

1.3
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

No literature data available for this compound.

Patent stripe

patents stripe