CID 75357445

(4-methyl-3,4-dihydro-2h-1,4-benzoxazin-6-yl)methanol

Structural Information

Molecular Formula
C10H13NO2
SMILES
CN1CCOC2=C1C=C(C=C2)CO
InChI
InChI=1S/C10H13NO2/c1-11-4-5-13-10-3-2-8(7-12)6-9(10)11/h2-3,6,12H,4-5,7H2,1H3
InChIKey
CEXPHEHOIYBJSS-UHFFFAOYSA-N
Compound name
(4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

179.09464 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.10192 137.2
[M+Na]+ 202.08386 150.6
[M+NH4]+ 197.12846 146.1
[M+K]+ 218.05780 144.4
[M-H]- 178.08736 140.5
[M+Na-2H]- 200.06931 142.6
[M]+ 179.09409 140.1
[M]- 179.09519 140.1
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