CID 16226780

93138-65-9

Structural Information

Molecular Formula
C12H18N2O
SMILES
CCN1CC(OC2=CC=CC=C21)CNC
InChI
InChI=1S/C12H18N2O/c1-3-14-9-10(8-13-2)15-12-7-5-4-6-11(12)14/h4-7,10,13H,3,8-9H2,1-2H3
InChIKey
SRHOYMFCVAJPNQ-UHFFFAOYSA-N
Compound name
1-(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.1419 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.14918 147.0
[M+Na]+ 229.13112 153.7
[M-H]- 205.13462 150.3
[M+NH4]+ 224.17572 164.4
[M+K]+ 245.10506 151.9
[M+H-H2O]+ 189.13916 139.6
[M+HCOO]- 251.14010 166.6
[M+CH3COO]- 265.15575 190.2
[M+Na-2H]- 227.11657 154.6
[M]+ 206.14135 146.5
[M]- 206.14245 146.5
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

No patent data available for this compound.